Compound Detail
CHEMBL279896
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Basic Information
| ChEMBL ID | CHEMBL279896 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JRQHRAVQASMXQD-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
375.5
MW (Da)
4.86
ALogP
3
HBA
1
HBD
61.5
PSA (Ų)
0.54
QED
0
Ro5 Violations
9
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.69
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Phosphodiesterase 4 CHEMBL2093863 | IC50 | 4.69 | 4.69 | 20300.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Phosphodiesterase 4 | IC50 | = | 20300.0 | nM | 4.69 | Inhibition of Phosphodiesterase 4 | 8568798 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 8568798 | 10.1021/jm9505066 | Phosphodiesterase 4 | 2 |
Data from ChEMBL 36 via Core Engine